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16827-25-1 | Carbamic acid, N-1-naphthalenyl-, 1-methylethyl ester
CAS No: 16827-25-1 Catalog No: AG001XYU MDL No:MFCD00087845
Product Description
Catalog Number:
AG001XYU
Chemical Name:
Carbamic acid, N-1-naphthalenyl-, 1-methylethyl ester
CAS Number:
16827-25-1
Molecular Formula:
C14H15NO2
Molecular Weight:
229.2744
MDL Number:
MFCD00087845
IUPAC Name:
propan-2-yl N-naphthalen-1-ylcarbamate
InChI:
InChI=1S/C14H15NO2/c1-10(2)17-14(16)15-13-9-5-7-11-6-3-4-8-12(11)13/h3-10H,1-2H3,(H,15,16)
InChI Key:
AEOQMGVPGAAJQS-UHFFFAOYSA-N
SMILES:
CC(OC(=O)Nc1cccc2c1cccc2)C
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.11g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.279g/mol
Monoisotopic Mass:
229.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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